N-[2-methyl-4-(3-methyl[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl)phenyl]-2-(2-nitrophenoxy)acetamide
Chemical Structure Depiction of
N-[2-methyl-4-(3-methyl[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl)phenyl]-2-(2-nitrophenoxy)acetamide
N-[2-methyl-4-(3-methyl[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl)phenyl]-2-(2-nitrophenoxy)acetamide
Compound characteristics
Compound ID: | F019-5715 |
Compound Name: | N-[2-methyl-4-(3-methyl[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl)phenyl]-2-(2-nitrophenoxy)acetamide |
Molecular Weight: | 424.44 |
Molecular Formula: | C19 H16 N6 O4 S |
Smiles: | Cc1cc(ccc1NC(COc1ccccc1[N+]([O-])=O)=O)c1nn2c(C)nnc2s1 |
Stereo: | ACHIRAL |
logP: | 2.2237 |
logD: | 2.2237 |
logSw: | -2.8723 |
Hydrogen bond acceptors count: | 10 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 97.617 |
InChI Key: | ZWGAFIREABEFFI-UHFFFAOYSA-N |